5-Hydroxyectoine
Properties
Property | Value |
---|---|
Formula | C6H10N2O3 |
IUPAC Name | (5s,6s)-5-hydroxy-2-methyl-1,4,5,6-tetrahydropyrimidin-3-ium-6-carboxylate |
Molecular Mass | 158.155 g·mol−1 |
Heat of Formation | -533.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 1.88 ± 1.08 D |
Volume | 183.24 Å 3 |
Surface Area | 177.3 Å 2 |
HOMO Energy | -9.57 ± 0.55 eV |
LUMO Energy | 3.38 ± eV |
Point Group Symmetry | C1 |
InChIKey | KIIBBJKLKFTNQO-WHFBIAKZSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |